Vitas-M small molecule compound
ethyl 2-(1,3-benzothiazol-2-ylamino)-4-{[(4-chlorophenyl)sulfanyl]methyl}pyrimidine-5-carboxylate
Catalog ID
STK209935
SMILES CCOC(=O)c1cnc(nc1CSc1ccc(cc1)Cl)Nc1nc2c(s1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H17ClN4O2S2 MW 456.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O2S2/c1-2-28-19(27)15-11-23-20(26-21-25-16-5-3-4-6-18(16)30-21)24-17(15)12-29-14-9-7-13(22)8-10-14/h3-11H,2,12H2,1H3,(H,23,24,25,26)InChIKey
DGCFWSYXSIRFRK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1CSC2=CC=C(C=C2)Cl)NC3=NC4=CC=CC=C4S3
ETHYL2(13BENZOTHIAZOL2YLAMINO)4(((4CHLOROPHENYL)SULFANYL)METHYL)PYRIMIDINE5CARBOXYLATE
ETHYL2(13BENZOTHIAZOL2YLAMINO)4((4CHLOROPHENYL)SULFANYLMETHYL)PYRIMIDINE5CARBOXYLATE
ETHYL2(BENZOTHIAZOL2YLAMINO)4((4CHLOROPHENYLTHIO)METHYL)PYRIMIDINE5CARBOXYLATE
InChI=1SC21H17ClN4O2S2c122819(27)15112320(26212516534618(16)3021)2417(15)1229149713(22)81014h311H212H21H3(H23242526)
MFCD05839727
ZINC000002327823
ZINC02327823
ZINC2327823
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